2-[1-ethyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-ethyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-ethyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-ethyl-5-(hydroxymethyl)-2-imidazolyl]thio]acetic acid IUPAC Name: 2-[1-ethyl-5-(hydroxymethyl)imidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[(1-ethyl-5-methylol-imidazol-2-yl)thio]acetic acid Formula: C8H12N2O3S MolecularWeight: 216.25748

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1SCC(=O)O)CO

Isomeric SMILES

CCN1C(=CN=C1SCC(=O)O)CO

InChI

InChI=1S/C8H12N2O3S/c1-2-10-6(4-11)3-9-8(10)14-5-7(12)13/h3,11H,2,4-5H2,1H3,(H,12,13)